Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 284.3 BDBM50305322Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
17-beta-hydroxysteroid dehydrogenase type 3 (Homo sapiens (Human))	BDBM50305322 (7-hydroxy-4-(phenylthiomethyl)-2H-chromen-2-one | ...) Show SMILES Oc1ccc2c(CSc3ccccc3)cc(=O)oc2c1 Show InChI InChI=1S/C16H12O3S/c17-12-6-7-14-11(8-16(18)19-15(14)9-12)10-20-13-4-2-1-3-5-13/h1-9,17H,10H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	93	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Chemical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human 17beta-HSD3 expressed in HeLa cells				Bioorg Med Chem Lett 20: 272-5 (2010) Article DOI: 10.1016/j.bmcl.2009.10.111 BindingDB Entry DOI: 10.7270/Q2SF2W8B
					More data for this Ligand-Target Pair